N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide

C15H18F3NO2 — CID 62366302

IUPACN-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)NC1CCCCC1O
InChIInChI=1S/C15H18F3NO2/c16-15(17,18)11-7-5-10(6-8-11)9-14(21)19-12-3-1-2-4-13(12)20/h5-8,12-13,20H,1-4,9H2,(H,19,21)
InChIKeyUUGAILICKYNVJA-UHFFFAOYSA-N
MW301.31 g/mol
LogP2.67
Rot. Bonds3

About N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide

N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 62366302) has the molecular formula C15H18F3NO2 and a molecular weight of 301.31 g/mol. Its IUPAC name is N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID62366302
Molecular FormulaC15H18F3NO2
Molecular Weight301.31 g/mol
Exact Mass301.13
IUPAC NameN-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)NC1CCCCC1O
InChIInChI=1S/C15H18F3NO2/c16-15(17,18)11-7-5-10(6-8-11)9-14(21)19-12-3-1-2-4-13(12)20/h5-8,12-13,20H,1-4,9H2,(H,19,21)
InChIKeyUUGAILICKYNVJA-UHFFFAOYSA-N
XLogP2.67
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.31
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-hydroxycyclohexyl)-3-[[4-(trifluoromethyl)phenyl]methyl]urea
CID 110933203
N-[2-(aminomethyl)cyclohexyl]-2-[4-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119611009
N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide
CID 62361084
2-(4-bromophenyl)-N-[(1S,2R)-2-hydroxycyclohexyl]acetamide
CID 94414749
1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanone
CID 62114725
N-[(1R,2R)-2-hydroxycyclohexyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 104927390
N-[(3S)-pyrrolidin-3-yl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 79688212
N-[(1R,2R)-2-hydroxycyclohexyl]-2-naphthalen-2-ylacetamide
CID 104927093
2-bromo-N-(2-hydroxycyclohexyl)acetamide
CID 63680498
cyclohexyl 2-[4-(trifluoromethyl)phenyl]acetate
CID 52537150
N-(2-hydroxycyclohexyl)-2-thiophen-3-ylacetamide
CID 62359044
N-pyrrolidin-3-yl-2-[4-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119452098

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide (CID 62366302) is N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide is O=C(Cc1ccc(C(F)(F)F)cc1)NC1CCCCC1O.
What is the InChIKey of N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is UUGAILICKYNVJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F3NO2/c16-15(17,18)11-7-5-10(6-8-11)9-14(21)19-12-3-1-2-4-13(12)20/h5-8,12-13,20H,1-4,9H2,(H,19,21).
What are the key properties of N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 301.31 g/mol, XLogP of 2.67, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 62366302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).